8-methoxy-7-(1-methylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine

C20H21N7O — CID 90289634

IUPAC8-methoxy-7-(1-methylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
SMILESCOc1c(-c2cnn(C)c2)cnc2ccc(Nc3cc(C(C)C)cnn3)nc12
InChIInChI=1S/C20H21N7O/c1-12(2)13-7-18(26-22-8-13)24-17-6-5-16-19(25-17)20(28-4)15(10-21-16)14-9-23-27(3)11-14/h5-12H,1-4H3,(H,24,25,26)
InChIKeyLZQFJFDIFQSULK-UHFFFAOYSA-N
MW375.44 g/mol
LogP3.70
Rot. Bonds5

About 8-methoxy-7-(1-methylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine

8-methoxy-7-(1-methylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine (PubChem CID 90289634) has the molecular formula C20H21N7O and a molecular weight of 375.44 g/mol. Its IUPAC name is 8-methoxy-7-(1-methylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine.

Molecular Properties

Compound Name8-methoxy-7-(1-methylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
PubChem CID90289634
Molecular FormulaC20H21N7O
Molecular Weight375.44 g/mol
Exact Mass375.18
IUPAC Name8-methoxy-7-(1-methylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine
SMILESCOc1c(-c2cnn(C)c2)cnc2ccc(Nc3cc(C(C)C)cnn3)nc12
InChIInChI=1S/C20H21N7O/c1-12(2)13-7-18(26-22-8-13)24-17-6-5-16-19(25-17)20(28-4)15(10-21-16)14-9-23-27(3)11-14/h5-12H,1-4H3,(H,24,25,26)
InChIKeyLZQFJFDIFQSULK-UHFFFAOYSA-N
XLogP3.70
TPSA90.64 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.44
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 8-methoxy-7-(1-methylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine?
The IUPAC name of 8-methoxy-7-(1-methylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine (CID 90289634) is 8-methoxy-7-(1-methylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine.
What is the SMILES notation for 8-methoxy-7-(1-methylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine?
The canonical SMILES for 8-methoxy-7-(1-methylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine is COc1c(-c2cnn(C)c2)cnc2ccc(Nc3cc(C(C)C)cnn3)nc12.
What is the InChIKey of 8-methoxy-7-(1-methylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine?
The InChIKey is LZQFJFDIFQSULK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N7O/c1-12(2)13-7-18(26-22-8-13)24-17-6-5-16-19(25-17)20(28-4)15(10-21-16)14-9-23-27(3)11-14/h5-12H,1-4H3,(H,24,25,26).
What are the key properties of 8-methoxy-7-(1-methylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine?
8-methoxy-7-(1-methylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine has a molecular weight of 375.44 g/mol, XLogP of 3.70, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-7-(1-methylpyrazol-4-yl)-N-(5-propan-2-ylpyridazin-3-yl)-1,5-naphthyridin-2-amine is sourced from PubChem (CID 90289634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).